(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine

C15H15FN2O — CID 114522053

IUPAC(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine
SMILESNC(c1cccc(OC2CC2)c1)c1ncccc1F
InChIInChI=1S/C15H15FN2O/c16-13-5-2-8-18-15(13)14(17)10-3-1-4-12(9-10)19-11-6-7-11/h1-5,8-9,11,14H,6-7,17H2
InChIKeyBWAWFPADBQVVEK-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.81
Rot. Bonds4

About (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine

(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine (PubChem CID 114522053) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine
PubChem CID114522053
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC Name(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine
SMILESNC(c1cccc(OC2CC2)c1)c1ncccc1F
InChIInChI=1S/C15H15FN2O/c16-13-5-2-8-18-15(13)14(17)10-3-1-4-12(9-10)19-11-6-7-11/h1-5,8-9,11,14H,6-7,17H2
InChIKeyBWAWFPADBQVVEK-UHFFFAOYSA-N
XLogP2.81
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-cyclobutylphenyl)-(3-fluoro-2-pyridinyl)methanamine
CID 114604283
(3-cyclopropyloxyphenyl)-(3,4-difluorophenyl)methanamine
CID 114521500
(3-cyclopropyloxyphenyl)-(3,5-difluorophenyl)methanamine
CID 114521611
(4-cyclobutylphenyl)-(3-fluoro-2-pyridinyl)methanamine
CID 116506384
(3-fluoro-2-pyridinyl)-(4-methoxyphenyl)methanamine
CID 78018909
(S)-(4-chloro-3-fluorophenyl)-(3-fluoro-2-pyridinyl)methanamine
CID 71165432
(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine
CID 105066137
(3-cyclopropyloxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 114521398
(2S)-2-amino-2-(3-cyclopropyloxyphenyl)ethanol
CID 129319999
(3-chloro-4-iodophenyl)-(3-cyclopropyloxyphenyl)methanamine
CID 103216448
(4-bromothiophen-2-yl)-(3-cyclopropyloxyphenyl)methanamine
CID 114521727
(3-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729975

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine?
The IUPAC name of (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine (CID 114522053) is (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine is NC(c1cccc(OC2CC2)c1)c1ncccc1F.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine?
The InChIKey is BWAWFPADBQVVEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c16-13-5-2-8-18-15(13)14(17)10-3-1-4-12(9-10)19-11-6-7-11/h1-5,8-9,11,14H,6-7,17H2.
What are the key properties of (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine?
(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine has a molecular weight of 258.30 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine is sourced from PubChem (CID 114522053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).